Vitas-M small molecule compound

methyl 3-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-3-(4-methylphenyl)propanoate

Catalog ID
STL539037
SMILES COC(=O)CC(c1c(O)ccc2c1occ(c2=O)c1ccc(cc1)O)c1ccc(cc1)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H22O6 MW 430.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22O6/c1-15-3-5-16(6-4-15)20(13-23(29)31-2)24-22(28)12-11-19-25(30)21(14-32-26(19)24)17-7-9-18(27)10-8-17/h3-12,14,20,27-28H,13H2,1-2H3
InChIKey
MMMDMGIDPUTDKC-UHFFFAOYSA-N
Synonyms
1574401-68-5
1574401685
71827085
InChI=1SC26H22O6c1153516(6415)20(1323(29)312)2422(28)12111925(30)21(143226(19)24)177918(27)10817h31214202728H13H212H3
methyl3(7hydroxy3(4hydroxyphenyl)4oxo4Hchromen8yl)3(4methylphenyl)propanoate
METHYL3(7HYDROXY3(4HYDROXYPHENYL)4OXO4HCHROMEN8YL)3(PTOLYL)PROPANOATE
methyl3(7hydroxy3(4hydroxyphenyl)4oxochromen8yl)3(4methylphenyl)propanoate
MFCD28050835
ZINC000096114201
ZINC000096114202

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.